>compound Cyanidin-3-O-(2''-O-beta-glucopyranosyl-beta-glucopyranoside)_Cyanidin-3-O-(2''-O-beta-glucopyranosyl-beta-glucopyranoside)
#instrument UPLC Q-Tof Premier, Waters
>formula C27H31O16
#smiles c(c(c([o+1]4)c(cc(c(O)5)c(cc(O)c5)4)OC(O2)C(OC(O3)C(C(C(C3CO)O)O)O)C(C(C2CO)O)O)1)c(O)c(O)cc1
#RECORD LC-ESI-QTOF_train_data/PR100917.txt;LC-ESI-QTOF_train_data/PR100458.txt
>charge -1
>ionization [M-2H]-
>parentmass 609.14558

>collision 5-60
147.0093 74.89
255.0323 152.2
256.0392 89.48
283.0255 169.0
284.0338 1433.0
285.0416 109.3
339.0533 186.4
609.1456 1143.0

>collision 5-60
213.0567 47.98
287.0564 4418.0
288.0616 60.38
611.1612 927.9

